azepan-1-yl-[6-cyclopropyl-3-methyl-1-(phenylmethyl)pyrazolo[3,4-b]pyridin-4-yl]methanone

Systemtic Name: azepan-1-yl-[6-cyclopropyl-3-methyl-1-(phenylmethyl)pyrazolo[3,4-b]pyridin-4-yl]methanone Openeye Name: azepan-1-yl-(1-benzyl-6-cyclopropyl-3-methyl-pyrazolo[3,4-b]pyridin-4-yl)methanone CAS Name: 1-azepanyl-[6-cyclopropyl-3-methyl-1-(phenylmethyl)-4-pyrazolo[3,4-b]pyridinyl]methanone IUPAC Name: azepan-1-yl-(1-benzyl-6-cyclopropyl-3-methylpyrazolo[3,4-b]pyridin-4-yl)methanone Traditional Name: azepan-1-yl-(1-benzyl-6-cyclopropyl-3-methyl-pyrazolo[3,4-b]pyridin-4-yl)methanone Formula: C24H28N4O MolecularWeight: 388.50532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3CC3)C(=O)N4CCCCCC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3CC3)C(=O)N4CCCCCC4)CC5=CC=CC=C5

InChI

InChI=1S/C24H28N4O/c1-17-22-20(24(29)27-13-7-2-3-8-14-27)15-21(19-11-12-19)25-23(22)28(26-17)16-18-9-5-4-6-10-18/h4-6,9-10,15,19H,2-3,7-8,11-14,16H2,1H3